SCHEMBL7705223

SCHEMBL7705223

COc1ccc(C2CC(=O)N(CCN3CCOCC3)C2)c2c1oc1ccccc12

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 3/20 0.59
CREBBP Q92793 1/20 0.44
HTT P42858 1/20 0.42
MAOB P27338 1/20 0.42
PRKDC P78527 2/20 0.40
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 2/20 0.39
NPC1 O15118 1/20 0.39
LMNA P02545 1/20 0.39
MAOA P21397 1/20 0.39
RAB9A P51151 1/20 0.39
MAPT P10636 2/20 0.39
GAA P10253 1/20 0.39
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8271489 0.87 PDE10A (0.63) PDE10AALDH1A1KDM4ENPC1LMNA
SCHEMBL2577993 0.86 PDE10A (0.59) PDE10AHTTPRKDCALDH1A1KDM4E
SCHEMBL8272011 0.86 PDE10A (0.62) PDE10AALDH1A1KDM4ENPC1LMNA
SCHEMBL8271479 0.86 PDE10A (0.66) PDE10AALDH1A1KDM4ENPC1LMNA
SCHEMBL8271478 0.83 PDE10A (0.63) PDE10AALDH1A1KDM4ENPC1LMNA
SCHEMBL8272031 0.83 PDE10A (0.59) PDE10AALDH1A1KDM4ENPC1LMNA
SCHEMBL8271339 0.82 PDE10A (0.59) PDE10AALDH1A1KDM4ENPC1LMNA
SCHEMBL8271493 0.82 PDE10A (0.65) PDE10AHTTALDH1A1KDM4ENPC1
SCHEMBL8271931 0.82 PDE10A (0.64) PDE10AALDH1A1KDM4ENPC1LMNA
SCHEMBL8272028 0.81 PDE10A (0.75) PDE10AALDH1A1KDM4ENPC1LMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011132051-A2 TRICYCLE COMPOUNDS AS PHOSPHODIESTERASE-10 INHIBITORS GLENMARK PHARMACEUTICALS S.A. (CH) 2011-10-27 WO disclosed